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Open-Source Quantum Chemistry – an electronic structure package in C++ driven by Python
C++ GNU Lesser General Public License v3.0 UpdatedOct 2, 2024 -
forte Public
Forked from evangelistalab/forteC++ GNU Lesser General Public License v3.0 UpdatedSep 30, 2024 -
qforte Public
Forked from evangelistalab/qfortePython GNU Lesser General Public License v3.0 UpdatedSep 12, 2024 -
psi4fockci Public
Forked from shannonhouck/psi4fockciA quick Psi4 implementation of SF-IP/EA.
Python BSD 3-Clause "New" or "Revised" License UpdatedMay 9, 2024 -
madness Public
Forked from m-a-d-n-e-s-s/madnessMultiresolution Adaptive Numerical Environment for Scientific Simulation
C++ GNU General Public License v2.0 UpdatedFeb 6, 2024 -
libint Public
Forked from evaleev/libintLibint: high-performance library for computing Gaussian integrals in quantum mechanics
C++ Other UpdatedDec 15, 2023 -
ambit Public
Forked from jturney/ambitC++ library for the implementation of tensor product calculations through a clean, concise user interface.
C++ GNU Lesser General Public License v3.0 UpdatedOct 2, 2023 -
PsiCon2020 Public
Forked from psi4/PsiCon2020materials from PsiCon 2020
Jupyter Notebook UpdatedDec 16, 2022 -
v2rdm_casscf Public
Forked from loriab/v2rdm_casscfA variational 2-RDM-driven CASSCF plugin to Psi4
C++ UpdatedAug 11, 2022 -
psi4numpy Public
Forked from psi4/psi4numpyCombining Psi4 and Numpy for education and development.
Jupyter Notebook BSD 3-Clause "New" or "Revised" License UpdatedJul 20, 2022 -
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summer-program Public
Forked from CCQC/summer-programRepository for all summer program related programs
Python UpdatedAug 15, 2017